Cas no 35363-39-4 (Carbonic acid, ethyl 1-methylethyl ester)
35363-39-4 structure
Product Name:Carbonic acid, ethyl 1-methylethyl ester
CAS No:35363-39-4
MF:C6H12O3
MW:132.157682418823
CID:920255
PubChem ID:17768163
Update Time:2025-04-19
Carbonic acid, ethyl 1-methylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbonic acid, ethyl 1-methylethyl ester
- ethyl propan-2-yl carbonate
- isopropyl ethyl carbonate
- 35363-39-4
- DTXSID60590896
- SCHEMBL187616
-
- Inchi： 1S/C6H12O3/c1-4-8-6(7)9-5(2)3/h5H,4H2,1-3H3
- InChI Key： AEHVMUMGWLAZNV-UHFFFAOYSA-N
- SMILES： O(C(=O)OCC)C(C)C
Computed Properties
- Exact Mass: 132.07866
- Monoisotopic Mass: 132.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 88.3
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.7
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Carbonic acid, ethyl 1-methylethyl ester Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
35363-39-4 (Carbonic acid, ethyl 1-methylethyl ester) Related Products
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